N-[2-chloro-4-[5-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-chloro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[4-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]phenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide

C85H81Cl2F2N11O12 — CID 167583916

IUPACN-[2-chloro-4-[5-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-chloro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[4-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]phenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide
SMILESCCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cnoc3C)cc2)c(F)c1.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cnoc3C)cn2)cc1Cl.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cnoc3C)nc2)cc1Cl.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cnoc3C)nc2)cc1F
InChIInChI=1S/C22H21FN2O3.2C21H20ClN3O3.C21H20FN3O3/c1-4-22(27)25(3)18-9-10-19(20(23)12-18)15-5-7-16(8-6-15)21(26)11-17-13-24-28-14(17)2;1-4-21(27)25(3)19-8-6-14(9-17(19)22)18-7-5-15(11-23-18)20(26)10-16-12-24-28-13(16)2;2*1-4-21(27)25(3)19-8-6-14(9-17(19)22)15-5-7-18(23-11-15)20(26)10-16-12-24-28-13(16)2/h5-10,12-13H,4,11H2,1-3H3;3*5-9,11-12H,4,10H2,1-3H3
InChIKeyHNPRSJYTDJGPJK-UHFFFAOYSA-N
MW1557.55 g/mol
LogP17.56
Rot. Bonds24

About N-[2-chloro-4-[5-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-chloro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[4-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]phenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide

N-[2-chloro-4-[5-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-chloro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[4-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]phenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide (PubChem CID 167583916) has the molecular formula C85H81Cl2F2N11O12 and a molecular weight of 1557.55 g/mol. Its IUPAC name is N-[2-chloro-4-[5-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-chloro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[4-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]phenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide.

Molecular Properties

Compound NameN-[2-chloro-4-[5-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-chloro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[4-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]phenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide
PubChem CID167583916
Molecular FormulaC85H81Cl2F2N11O12
Molecular Weight1557.55 g/mol
Exact Mass1555.54
IUPAC NameN-[2-chloro-4-[5-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-chloro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[4-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]phenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide
SMILESCCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cnoc3C)cc2)c(F)c1.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cnoc3C)cn2)cc1Cl.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cnoc3C)nc2)cc1Cl.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cnoc3C)nc2)cc1F
InChIInChI=1S/C22H21FN2O3.2C21H20ClN3O3.C21H20FN3O3/c1-4-22(27)25(3)18-9-10-19(20(23)12-18)15-5-7-16(8-6-15)21(26)11-17-13-24-28-14(17)2;1-4-21(27)25(3)19-8-6-14(9-17(19)22)18-7-5-15(11-23-18)20(26)10-16-12-24-28-13(16)2;2*1-4-21(27)25(3)19-8-6-14(9-17(19)22)15-5-7-18(23-11-15)20(26)10-16-12-24-28-13(16)2/h5-10,12-13H,4,11H2,1-3H3;3*5-9,11-12H,4,10H2,1-3H3
InChIKeyHNPRSJYTDJGPJK-UHFFFAOYSA-N
XLogP17.56
TPSA292.31 Ų
H-Bond Donors
H-Bond Acceptors19
Rotatable Bonds24
Heavy Atoms112
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001557.55
LogP ≤ 517.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1019

Analyze N-[2-chloro-4-[5-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-chloro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[4-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]phenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide with MolForge

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Related Compounds

3-[3-(2-Chloro-4-methylphenyl)-1,2-oxazol-5-yl]-1-(6-methyl-3-pyridinyl)propan-1-one;3-[3-(2-chlorophenyl)-1,2-oxazol-5-yl]-1-(6-methyl-3-pyridinyl)propan-1-one;3-[3-(2-fluorophenyl)-1,2-oxazol-5-yl]-1-(6-methyl-3-pyridinyl)propan-1-one;bis(3-[3-(4-methylphenyl)-1,2-oxazol-5-yl]-1-(6-methyl-3-pyridinyl)propan-1-one);1-(6-methyl-3-pyridinyl)-3-[3-[2-(trifluoromethyl)phenyl]-1,2-oxazol-5-yl]propan-1-one
CID 160751132
3-[3-(2-Chloro-4-methylphenyl)-1,2-oxazol-5-yl]-1-(2,5-dichloro-3-pyridinyl)propan-1-one;3-[3-(2-chlorophenyl)-1,2-oxazol-5-yl]-1-(2,5-dichloro-3-pyridinyl)propan-1-one;1-(2,5-dichloro-3-pyridinyl)-3-[3-(2-fluorophenyl)-1,2-oxazol-5-yl]propan-1-one;tris(1-(2,5-dichloro-3-pyridinyl)-3-[3-(4-methylphenyl)-1,2-oxazol-5-yl]propan-1-one)
CID 161486062
N-[3-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide
CID 167538670
N-[2-chloro-4-[4-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]phenyl]phenyl]-N-methylpropanamide;N-[3-chloro-4-[5-[2-(5-methyl-1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-chloro-4-[6-[2-(5-methyl-1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[4-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]phenyl]phenyl]-N-methylpropanamide
CID 167572176
N-[3-chloro-4-[4-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]phenyl]phenyl]-N-methylpropanamide;N-[2-chloro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[4-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]phenyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[4-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]phenyl]phenyl]propanamide
CID 167593699
N-[2-chloro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[2-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide
CID 167604795
N-[2-fluoro-4-[5-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[2-methyl-4-[4-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]phenyl]phenyl]propanamide;N-methyl-N-[2-methyl-4-[5-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[2-methyl-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]propanamide
CID 167616106
N-[3-chloro-4-[5-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-chloro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[5-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide
CID 167660570
N-[3-chloro-4-[4-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]phenyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[4-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]phenyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[5-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]propanamide
CID 167671904
N-[2-chloro-4-[4-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]phenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[4-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]phenyl]phenyl]-N-methylpropanamide;N-methyl-N-[2-methyl-4-[4-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]phenyl]phenyl]propanamide;N-methyl-N-[2-methyl-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]propanamide
CID 167672514
N-[3-chloro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-chloro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-[2-chloro-4-[4-[2-(1H-pyrazol-5-yl)acetyl]phenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[4-[2-(1H-pyrazol-5-yl)acetyl]phenyl]phenyl]-N-methylpropanamide
CID 167695165

Frequently Asked Questions

What is the IUPAC name of N-[2-chloro-4-[5-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-chloro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[4-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]phenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide?
The IUPAC name of N-[2-chloro-4-[5-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-chloro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[4-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]phenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide (CID 167583916) is N-[2-chloro-4-[5-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-chloro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[4-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]phenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide.
What is the SMILES notation for N-[2-chloro-4-[5-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-chloro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[4-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]phenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide?
The canonical SMILES for N-[2-chloro-4-[5-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-chloro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[4-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]phenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide is CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cnoc3C)cc2)c(F)c1.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cnoc3C)cn2)cc1Cl.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cnoc3C)nc2)cc1Cl.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cnoc3C)nc2)cc1F.
What is the InChIKey of N-[2-chloro-4-[5-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-chloro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[4-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]phenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide?
The InChIKey is HNPRSJYTDJGPJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21FN2O3.2C21H20ClN3O3.C21H20FN3O3/c1-4-22(27)25(3)18-9-10-19(20(23)12-18)15-5-7-16(8-6-15)21(26)11-17-13-24-28-14(17)2;1-4-21(27)25(3)19-8-6-14(9-17(19)22)18-7-5-15(11-23-18)20(26)10-16-12-24-28-13(16)2;2*1-4-21(27)25(3)19-8-6-14(9-17(19)22)15-5-7-18(23-11-15)20(26)10-16-12-24-28-13(16)2/h5-10,12-13H,4,11H2,1-3H3;3*5-9,11-12H,4,10H2,1-3H3.
What are the key properties of N-[2-chloro-4-[5-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-chloro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[4-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]phenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide?
N-[2-chloro-4-[5-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-chloro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[4-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]phenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide has a molecular weight of 1557.55 g/mol, XLogP of 17.56, 24 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-chloro-4-[5-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[2-chloro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[4-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]phenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[6-[2-(5-methyl-1,2-oxazol-4-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide is sourced from PubChem (CID 167583916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).